2-(2-chloro-6-fluorophenyl)-1-(5-chlorothiophen-2-yl)ethanol

C12H9Cl2FOS — CID 61087611

IUPAC2-(2-chloro-6-fluorophenyl)-1-(5-chlorothiophen-2-yl)ethanol
SMILESOC(Cc1c(F)cccc1Cl)c1ccc(Cl)s1
InChIInChI=1S/C12H9Cl2FOS/c13-8-2-1-3-9(15)7(8)6-10(16)11-4-5-12(14)17-11/h1-5,10,16H,6H2
InChIKeyXUYVQMWSALOQLN-UHFFFAOYSA-N
MW291.17 g/mol
LogP4.47
Rot. Bonds3

About 2-(2-chloro-6-fluorophenyl)-1-(5-chlorothiophen-2-yl)ethanol

2-(2-chloro-6-fluorophenyl)-1-(5-chlorothiophen-2-yl)ethanol (PubChem CID 61087611) has the molecular formula C12H9Cl2FOS and a molecular weight of 291.17 g/mol. Its IUPAC name is 2-(2-chloro-6-fluorophenyl)-1-(5-chlorothiophen-2-yl)ethanol.

Molecular Properties

Compound Name2-(2-chloro-6-fluorophenyl)-1-(5-chlorothiophen-2-yl)ethanol
PubChem CID61087611
Molecular FormulaC12H9Cl2FOS
Molecular Weight291.17 g/mol
Exact Mass289.97
IUPAC Name2-(2-chloro-6-fluorophenyl)-1-(5-chlorothiophen-2-yl)ethanol
SMILESOC(Cc1c(F)cccc1Cl)c1ccc(Cl)s1
InChIInChI=1S/C12H9Cl2FOS/c13-8-2-1-3-9(15)7(8)6-10(16)11-4-5-12(14)17-11/h1-5,10,16H,6H2
InChIKeyXUYVQMWSALOQLN-UHFFFAOYSA-N
XLogP4.47
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.17
LogP ≤ 54.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-(2-chloro-6-fluorophenyl)-1-(5-chlorothiophen-2-yl)ethanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(2-chloro-6-fluorophenyl)-1-(2,5-dichlorothiophen-3-yl)ethanol
CID 61083005
2-(2-chloro-6-fluorophenyl)-1-(4-methylphenyl)ethanol
CID 61100900
2-(2-chloro-6-fluorophenyl)-1-pyridin-4-ylethanol
CID 61495940
2-(2-chloro-6-fluorophenyl)-1-(3-chlorophenyl)ethanol
CID 61495863
(1S)-2-chloro-1-(5-chlorothiophen-2-yl)ethanol
CID 83001660
2-(2-chloro-6-fluorophenyl)-1-(2-fluoro-3-methylphenyl)ethanol
CID 81478146
2-(2-chloro-6-fluorophenyl)-1-(2,4,6-trimethylphenyl)ethanol
CID 63426367
2-(2-chloro-6-fluorophenyl)-1-(5-iodothiophen-3-yl)ethanol
CID 79691005
1-(3-chloro-2-fluorophenyl)-2-(2,6-difluorophenyl)ethanol
CID 81263148
1-(5-bromo-2-fluorophenyl)-2-(2-chloro-6-fluorophenyl)ethanol
CID 63017670
2-[1-bromo-2-(2-chloro-6-fluorophenyl)ethyl]-5-methylthiophene
CID 63435833
2-(2-chloro-6-fluorophenyl)-1-(1H-1,2,4-triazol-5-yl)ethanol
CID 65363109

Frequently Asked Questions

What is the IUPAC name of 2-(2-chloro-6-fluorophenyl)-1-(5-chlorothiophen-2-yl)ethanol?
The IUPAC name of 2-(2-chloro-6-fluorophenyl)-1-(5-chlorothiophen-2-yl)ethanol (CID 61087611) is 2-(2-chloro-6-fluorophenyl)-1-(5-chlorothiophen-2-yl)ethanol.
What is the SMILES notation for 2-(2-chloro-6-fluorophenyl)-1-(5-chlorothiophen-2-yl)ethanol?
The canonical SMILES for 2-(2-chloro-6-fluorophenyl)-1-(5-chlorothiophen-2-yl)ethanol is OC(Cc1c(F)cccc1Cl)c1ccc(Cl)s1.
What is the InChIKey of 2-(2-chloro-6-fluorophenyl)-1-(5-chlorothiophen-2-yl)ethanol?
The InChIKey is XUYVQMWSALOQLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9Cl2FOS/c13-8-2-1-3-9(15)7(8)6-10(16)11-4-5-12(14)17-11/h1-5,10,16H,6H2.
What are the key properties of 2-(2-chloro-6-fluorophenyl)-1-(5-chlorothiophen-2-yl)ethanol?
2-(2-chloro-6-fluorophenyl)-1-(5-chlorothiophen-2-yl)ethanol has a molecular weight of 291.17 g/mol, XLogP of 4.47, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chloro-6-fluorophenyl)-1-(5-chlorothiophen-2-yl)ethanol is sourced from PubChem (CID 61087611), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).